SCHEMBL7705422

SCHEMBL7705422

O=c1oc2ccccc2cc1C1NCc2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.44
HPGD P15428 2/20 0.44
TYR P14679 1/20 0.44
DAO P14920 1/20 0.44
AKR1B1 P15121 1/20 0.44
POLB P06746 1/20 0.44
RAB9A P51151 5/20 0.42
MAOB P27338 5/20 0.42
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 4/20 0.42
NPC1 O15118 4/20 0.41
NCOA1 Q15788 1/20 0.41
NCOA3 Q9Y6Q9 1/20 0.41
ESR1 P03372 1/20 0.41
GAPDH P04406 1/20 0.41
GAA P10253 1/20 0.41
ESR2 Q92731 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CA12 O43570 3/20 0.41
CA9 Q16790 3/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1562320 0.74 HSD17B3 (0.45) MAOBCA12CA1CA4CA5A
SCHEMBL1563501 0.74 PRCP (0.40) HPGDMAOBALDH1A1KDM4EGAA
SCHEMBL1563861 0.72 NPC1 (0.51) SMN1; SMN2HPGDPOLBRAB9AMAOB
SCHEMBL16669125 0.72 BCHE (0.65) SMN1; SMN2HPGDTYRDAOAKR1B1
SCHEMBL27806707 0.71 HPGD (0.44) SMN1; SMN2HPGDTYRDAOAKR1B1
SCHEMBL28548279 0.70 RAB9A (0.57) SMN1; SMN2HPGDTYRDAOAKR1B1
SCHEMBL31070628 0.69 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3
SCHEMBL31070458 0.67 SLC6A4 (0.49) SMN1; SMN2RAB9AALDH1A1KDM4ENPC1
SCHEMBL28699086 0.66 RAB9A (0.46) SMN1; SMN2HPGDTYRDAOAKR1B1
SCHEMBL31070671 0.66 SLC6A2 (0.53) GAASLC6A2SLC6A4SLC6A3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1222158-A1 RADICAL SCAVENGER THE PROCTER & GAMBLE COMPANY (US) 2002-07-17 EP disclosed
WO-2001028973-A1 RADICAL SCAVENGER THE PROCTER & GAMBLE COMPANY (US) 2001-04-26 WO disclosed
EP-1047762-A1 STABLE COLOURED THICKENED BLEACHING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2000-11-02 EP disclosed
EP-1017778-A1 BLEACHING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2000-07-12 EP disclosed
EP-1017779-A1 BLEACHING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2000-07-12 EP disclosed
EP-1017780-A1 STABLED THICKENED BLEACHING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2000-07-12 EP disclosed
EP-1015545-A1 STABLE BLEACHING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2000-07-05 EP disclosed
WO-1999036497-A1 STABLE COLOURED THICKENED BLEACHING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1999-07-22 WO disclosed
WO-1999015617-A1 BLEACHING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1999-04-01 WO disclosed
WO-1999015618-A1 STABLED THICKENED BLEACHING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1999-04-01 WO disclosed
WO-1999015616-A1 BLEACHING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1999-04-01 WO disclosed
WO-1999014305-A1 STABLE BLEACHING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1999-03-25 WO disclosed